4-(methylamino)butyl 2-(2-oxidanylidenebutyl)octadecyl hydrogen phosphate

Systemtic Name: 4-(methylamino)butyl 2-(2-oxidanylidenebutyl)octadecyl hydrogen phosphate Openeye Name: 4-(methylamino)butyl 2-(2-oxobutyl)octadecyl hydrogen phosphate CAS Name: 4-(methylamino)butyl 2-(2-oxobutyl)octadecyl hydrogen phosphate IUPAC Name: 4-(methylamino)butyl 2-(2-oxobutyl)octadecyl hydrogen phosphate Traditional Name: 2-(2-ketobutyl)octadecyl 4-(methylamino)butyl hydrogen phosphate Formula: C27H56NO5P MolecularWeight: 505.711001

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CC(=O)CC)COP(=O)(O)OCCCCNC

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CC(=O)CC)COP(=O)(O)OCCCCNC

InChI

InChI=1S/C27H56NO5P/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-21-26(24-27(29)5-2)25-33-34(30,31)32-23-20-19-22-28-3/h26,28H,4-25H2,1-3H3,(H,30,31)